#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ron s PRO 2 N 0.00 2.59 0.18 -0.72 0.04 -1.26 -4.96 135.00 130.87 1ron s PRO 2 Ca 0.00 0.82 -0.33 0.00 0.04 0.00 0.00 61.00 61.53 1ron s PRO 2 Cb 0.00 -1.96 -0.14 0.00 0.04 0.00 0.00 34.50 32.44 1ron s PRO 2 CO 0.00 -1.31 1.47 0.43 0.04 0.00 0.00 177.00 177.63 1ron n SER 3 N -3.25 2.75 -4.77 6.66 7.64 -1.26 -4.96 113.62 116.43 1ron n SER 3 Ca 0.07 1.11 -0.30 0.00 1.01 0.00 0.00 58.87 60.76 1ron n SER 3 Cb 0.55 -1.39 0.10 0.00 -1.01 0.00 0.00 64.21 62.45 1ron n SER 3 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1ron s LYS 4 N 0.33 1.98 0.00 1.43 3.01 -1.26 -5.08 119.74 120.14 1ron s LYS 4 Ca 0.75 0.90 0.00 0.00 -1.01 0.00 0.00 55.97 56.62 1ron s LYS 4 Cb -0.70 -1.89 0.00 0.00 -1.01 0.00 0.00 37.83 34.23 1ron s LYS 4 CO 0.44 -1.76 0.00 -0.35 0.51 0.00 0.00 175.35 174.19 1ron n PRO 5 N -3.57 0.22 -1.40 -1.68 -0.04 -1.26 -4.93 135.00 122.34 1ron n PRO 5 Ca 0.08 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.21 1ron n PRO 5 Cb 0.55 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.95 1ron n PRO 5 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ron n ASP 6 N -2.44 7.73 -4.81 3.54 2.03 -1.26 -4.91 116.55 116.43 1ron n ASP 6 Ca 0.00 -2.72 -0.38 0.00 0.52 0.00 0.00 54.79 52.21 1ron n ASP 6 Cb 0.00 -1.47 -0.06 0.00 -0.72 0.00 0.00 41.12 38.87 1ron n ASP 6 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1ron s ASN 7 N 1.63 6.81 -0.87 1.67 4.22 -1.26 -4.95 114.94 122.18 1ron s ASN 7 Ca 0.65 0.96 -0.12 0.00 -2.14 0.00 0.00 52.86 52.22 1ron s ASN 7 Cb 0.23 -2.27 -0.09 0.00 1.28 0.00 0.00 41.25 40.40 1ron s ASN 7 CO -0.07 0.26 2.04 -0.81 -2.04 0.00 0.00 177.10 176.48 1ron n PRO 8 N 2.19 1.88 0.00 3.55 -0.04 -1.26 -4.82 135.00 136.50 1ron n PRO 8 Ca -0.12 -1.63 0.00 0.00 -0.04 0.00 0.00 63.50 61.71 1ron n PRO 8 Cb 0.52 -2.64 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 1ron n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ron n GLY 9 N 4.06 1.25 3.26 0.55 0.00 -1.26 -4.81 105.19 108.24 1ron n GLY 9 Ca 0.46 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 1ron n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ron s GLU 10 N 0.00 0.43 0.00 1.61 -1.05 -1.26 -5.03 118.70 113.40 1ron s GLU 10 Ca 0.00 0.53 0.17 0.00 -0.15 0.00 0.00 54.97 55.52 1ron s GLU 10 Cb 0.00 0.20 0.58 0.00 -0.44 0.00 0.00 34.13 34.47 1ron s GLU 10 CO 0.00 -0.06 1.44 -0.25 0.95 0.00 0.00 175.26 177.34 1ron n ASP 11 N 2.96 1.69 -2.01 0.83 9.92 -1.26 -4.34 116.55 124.34 1ron n ASP 11 Ca -0.14 -1.82 -0.08 0.00 -0.53 0.00 0.00 54.79 52.23 1ron n ASP 11 Cb 0.57 -0.15 0.29 0.00 -0.64 0.00 0.00 41.12 41.19 1ron n ASP 11 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ron n ALA 12 N 0.37 4.68 0.28 2.24 0.00 -1.26 -4.68 120.51 122.14 1ron n ALA 12 Ca 0.14 -2.42 0.14 0.00 0.00 0.00 0.00 53.44 51.31 1ron n ALA 12 Cb 0.31 -1.26 0.43 0.00 0.00 0.00 0.00 19.45 18.93 1ron n ALA 12 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ron h PRO 13 N 2.49 0.00 -0.10 0.00 0.13 -2.00 -0.25 132.00 132.26 1ron h PRO 13 Ca 0.30 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.46 1ron h PRO 13 Cb 2.38 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 33.51 1ron h PRO 13 CO 0.77 0.00 0.22 0.00 -0.23 0.00 0.00 178.00 178.76 1ron h ALA 14 N 2.05 1.50 0.00 -0.56 0.00 -1.95 0.65 119.26 120.95 1ron h ALA 14 Ca 0.00 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1ron h ALA 14 Cb 0.73 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1ron h ALA 14 CO 0.00 -0.27 -1.49 0.39 0.00 0.00 0.00 179.25 177.88 1ron n GLU 15 N -3.34 0.63 0.07 0.00 4.71 -0.11 -2.41 120.64 120.20 1ron n GLU 15 Ca -0.00 0.20 -0.20 0.00 -0.01 0.00 0.00 57.16 57.14 1ron n GLU 15 Cb 0.31 -1.78 -0.15 0.00 -1.01 0.00 0.00 31.44 28.81 1ron n GLU 15 CO 0.00 0.00 0.00 0.22 0.09 0.00 0.00 177.13 177.44 1ron h ASP 16 N 0.00 0.52 -0.18 1.62 3.58 0.04 0.11 116.42 122.12 1ron h ASP 16 Ca -0.18 -0.75 -0.07 0.00 0.42 0.00 0.00 57.03 56.45 1ron h ASP 16 Cb 1.60 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.46 1ron h ASP 16 CO 0.04 1.63 -0.10 0.24 -2.88 0.00 0.00 179.24 178.16 1ron h MET 17 N 0.09 0.54 0.66 0.28 0.00 -0.60 0.65 114.93 116.56 1ron h MET 17 Ca -0.30 -0.15 -0.03 0.00 0.00 0.00 0.00 59.70 59.23 1ron h MET 17 Cb 2.07 -0.06 -0.01 0.00 0.00 0.00 0.00 31.60 33.60 1ron h MET 17 CO 0.17 0.64 -0.47 0.00 0.00 0.00 0.00 176.91 177.26 1ron h ALA 18 N 1.39 -1.15 0.00 6.32 0.00 -1.41 0.41 119.26 124.82 1ron h ALA 18 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ron h ALA 18 Cb 0.48 0.61 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ron h ALA 18 CO 0.03 -1.17 0.32 0.00 0.00 0.00 0.00 179.25 178.42 1ron h ARG 19 N -1.08 0.00 0.04 0.00 3.08 0.99 0.46 114.38 117.87 1ron h ARG 19 Ca -0.08 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.68 1ron h ARG 19 Cb 0.89 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 1ron h ARG 19 CO 0.05 0.00 -1.56 1.88 -1.07 0.00 0.00 179.97 179.27 1ron h TYR 20 N 0.00 0.15 0.00 3.04 -1.99 0.44 1.12 116.97 119.73 1ron h TYR 20 Ca 0.00 -0.11 0.00 0.00 2.00 0.00 0.00 58.73 60.62 1ron h TYR 20 Cb 0.63 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.36 1ron h TYR 20 CO 0.00 1.17 0.00 0.66 -0.00 0.00 0.00 178.16 179.99 1ron n TYR 21 N -3.24 0.64 -0.14 4.88 4.01 0.28 0.68 117.16 124.27 1ron n TYR 21 Ca -0.15 0.27 -0.26 0.00 -0.16 0.00 0.00 57.90 57.59 1ron n TYR 21 Cb 1.03 -0.93 -0.11 0.00 -0.31 0.00 0.00 39.34 39.02 1ron n TYR 21 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1ron n SER 22 N -2.10 1.96 0.12 7.72 2.88 -1.15 -3.97 113.62 119.09 1ron n SER 22 Ca 0.02 0.20 -0.13 0.00 -1.33 0.00 0.00 58.87 57.62 1ron n SER 22 Cb 0.18 -0.69 -0.08 0.00 -0.75 0.00 0.00 64.21 62.86 1ron n SER 22 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ron h ALA 23 N -0.70 -0.31 -0.49 -1.46 0.00 0.20 0.92 119.26 117.42 1ron h ALA 23 Ca -0.67 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 53.96 1ron h ALA 23 Cb 1.70 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.59 1ron h ALA 23 CO -0.33 -0.53 -0.14 -0.07 0.00 0.00 0.00 179.25 178.19 1ron h LEU 24 N -0.60 0.94 0.07 0.00 -0.00 0.01 0.95 115.31 116.68 1ron h LEU 24 Ca -0.03 -0.32 -0.00 0.00 -0.00 0.00 0.00 57.88 57.53 1ron h LEU 24 Cb 0.43 -0.26 0.00 0.00 -0.00 0.00 0.00 40.66 40.84 1ron h LEU 24 CO 0.05 1.08 -0.03 -0.09 -0.00 0.00 0.00 178.44 179.45 1ron h ARG 25 N 0.83 -0.09 -0.16 1.13 2.43 -1.53 0.27 114.38 117.27 1ron h ARG 25 Ca 0.13 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.31 1ron h ARG 25 Cb 0.68 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 1ron h ARG 25 CO 0.05 -0.01 0.11 1.25 -1.51 0.00 0.00 179.97 179.86 1ron h HIS 26 N -0.14 0.19 0.53 2.20 2.76 0.18 -1.56 115.15 119.30 1ron h HIS 26 Ca -0.01 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 1ron h HIS 26 Cb 0.11 -0.06 0.01 0.00 1.55 0.00 0.00 27.41 29.01 1ron h HIS 26 CO -0.06 0.12 -0.25 1.88 -1.30 0.00 0.00 177.93 178.31 1ron h TYR 27 N 0.20 -0.66 -0.76 5.26 0.05 0.25 0.26 116.97 121.56 1ron h TYR 27 Ca 0.06 -0.02 0.22 0.00 0.05 0.00 0.00 58.73 59.05 1ron h TYR 27 Cb 0.01 0.22 -0.03 0.00 1.01 0.00 0.00 36.73 37.94 1ron h TYR 27 CO -0.00 -0.37 0.58 0.97 -1.05 0.00 0.00 178.16 178.29 1ron h ILE 28 N -0.82 0.55 0.09 -2.88 6.09 0.47 1.44 117.51 122.44 1ron h ILE 28 Ca -0.07 0.00 -0.26 0.00 -1.37 0.00 0.00 64.86 63.16 1ron h ILE 28 Cb 0.59 0.59 0.00 0.00 0.47 0.00 0.00 36.82 38.47 1ron h ILE 28 CO 0.12 0.00 -1.14 0.78 -3.07 0.00 0.00 178.15 174.84 1ron h ASN 29 N 0.00 0.43 0.31 2.19 2.35 -0.90 -1.65 115.58 118.31 1ron h ASN 29 Ca 0.36 -0.42 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1ron h ASN 29 Cb 1.51 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.75 1ron h ASN 29 CO -0.00 1.29 -0.96 -0.11 -1.65 0.00 0.00 177.43 176.00 1ron n LEU 30 N -3.59 0.67 -0.03 1.61 -0.00 0.82 -4.12 117.00 112.36 1ron n LEU 30 Ca -0.08 -0.15 -0.18 0.00 -0.00 0.00 0.00 56.01 55.61 1ron n LEU 30 Cb 0.96 -0.10 -0.14 0.00 -0.00 0.00 0.00 43.42 44.15 1ron n LEU 30 CO 0.53 0.11 -0.88 0.00 -0.00 0.00 0.00 177.39 177.15 1ron n ILE 31 N -1.76 1.68 -0.17 1.96 3.06 0.47 -3.52 119.36 121.08 1ron n ILE 31 Ca 0.03 -0.68 -0.03 0.00 -2.50 0.00 0.00 62.75 59.58 1ron n ILE 31 Cb 0.39 -1.49 0.04 0.00 0.54 0.00 0.00 39.64 39.12 1ron n ILE 31 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1ron h THR 32 N 0.04 0.44 0.00 9.51 1.03 -1.45 0.76 112.91 123.24 1ron h THR 32 Ca -0.44 0.00 -0.02 0.00 -0.01 0.00 0.00 66.41 65.94 1ron h THR 32 Cb 2.02 0.44 -0.00 0.00 -1.07 0.00 0.00 68.15 69.54 1ron h THR 32 CO 0.05 0.00 -0.09 0.08 -0.01 0.00 0.00 175.52 175.55 1ron h ARG 33 N -0.02 0.00 0.11 0.00 0.11 -1.73 0.19 114.38 113.03 1ron h ARG 33 Ca 0.25 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.33 1ron h ARG 33 Cb 0.41 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.49 1ron h ARG 33 CO -0.55 0.09 -0.05 1.96 0.10 0.00 0.00 179.97 181.51 1ron h GLN 34 N 0.00 -0.14 -0.82 0.08 1.08 0.23 -3.34 115.11 112.20 1ron h GLN 34 Ca -0.00 0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.24 1ron h GLN 34 Cb 0.17 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.59 1ron h GLN 34 CO 0.01 -0.09 0.54 0.07 -0.95 0.00 0.00 178.83 178.41 1ron h ARG 35 N -0.34 1.00 -0.02 1.46 0.11 -0.20 -3.51 114.38 112.87 1ron h ARG 35 Ca -0.02 -0.06 0.00 0.00 0.10 0.00 0.00 59.98 60.00 1ron h ARG 35 Cb 0.11 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 30.97 1ron h ARG 35 CO 0.02 0.66 0.00 0.66 0.10 0.00 0.00 179.97 181.41